4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrol-3-yl]carbonyl-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrol-3-yl]carbonyl-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrole-3-carbonyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methylpyrrole-3-carbonyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrole-3-carbonyl]-N-phenyl-piperazine-1-carboxamide Formula: C29H26ClFN4O2 MolecularWeight: 516.993743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC(=CC=C2)F)C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(N1C2=CC(=CC=C2)F)C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C29H26ClFN4O2/c1-20-26(28(36)33-14-16-34(17-15-33)29(37)32-24-7-3-2-4-8-24)19-27(21-10-12-22(30)13-11-21)35(20)25-9-5-6-23(31)18-25/h2-13,18-19H,14-17H2,1H3,(H,32,37)